D2T
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| OD1 | CG | doub | 1.21Å | 1.24Å | |
| OD2 | CG | sing | 1.34Å | 1.25Å | |
| CG | CB | sing | 1.51Å | 1.55Å | |
| N | CA | sing | 1.47Å | 1.48Å | |
| SB | CB | sing | 1.81Å | 1.85Å | |
| SB | CB1 | sing | 1.81Å | 1.81Å | |
| CB | CA | sing | 1.53Å | 1.56Å | |
| CA | C | sing | 1.51Å | 1.55Å | |
| C | O | doub | 1.21Å | 1.22Å | |
| C | OXT | sing | 1.34Å | 1.32Å | |
| N | H | sing | 1.01Å | 1.00Å | |
| N | H2 | sing | 1.01Å | 1.00Å | |
| CA | HA | sing | 1.09Å | 1.10Å | |
| CB | H5 | sing | 1.09Å | 1.10Å | |
| CB1 | H6 | sing | 1.09Å | 1.10Å | |
| CB1 | H7 | sing | 1.09Å | 1.10Å | |
| CB1 | H8 | sing | 1.09Å | 1.10Å | |
| OD2 | H9 | sing | 0.97Å | 0.95Å | |
| OXT | HXT | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| OD1 | CG | OD2 | 125.9° | 120.1° |
| OD1 | CG | CB | 117.4° | 119.9° |
| OD2 | CG | CB | 116.7° | 120.0° |
| CG | OD2 | H9 | 109.5° | 117.0° |
| CG | CB | SB | 114.1° | 109.5° |
| CG | CB | CA | 108.8° | 109.5° |
| CG | CB | H5 | 110.6° | 109.5° |
| N | CA | CB | 113.8° | 109.5° |
| N | CA | C | 109.6° | 109.5° |
| CA | N | H | 109.5° | 111.0° |
| CA | N | H2 | 109.5° | 111.0° |
| N | CA | HA | 108.0° | 109.5° |
| CB | SB | CB1 | 102.9° | 103.0° |
| SB | CB | CA | 105.7° | 109.5° |
| SB | CB | H5 | 107.2° | 109.4° |
| SB | CB1 | H6 | 109.5° | 109.5° |
| SB | CB1 | H7 | 109.5° | 109.5° |
| SB | CB1 | H8 | 109.5° | 109.5° |
| CB | CA | C | 111.1° | 109.4° |
| CB | CA | HA | 107.0° | 109.4° |
| CA | CB | H5 | 110.4° | 109.4° |
| CA | C | O | 123.3° | 120.0° |
| CA | C | OXT | 114.0° | 120.0° |
| C | CA | HA | 107.1° | 109.5° |
| O | C | OXT | 122.7° | 120.0° |
| C | OXT | HXT | 109.5° | 117.1° |
| H | N | H2 | 109.5° | 111.0° |
| H6 | CB1 | H7 | 109.5° | 109.5° |
| H6 | CB1 | H8 | 109.5° | 109.5° |
| H7 | CB1 | H8 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| OD1 | CG | OD2 | CB | 180.0° | 180.0° |
| OD1 | CG | CB | SB | 107.7° | 90.0° |
| OD1 | CG | CB | CA | 10.0° | 30.0° |
| OD1 | CG | CB | H5 | 131.4° | 150.0° |
| OD1 | CG | OD2 | H9 | 0.0° | 0.0° |
| OD2 | CG | CB | SB | 72.3° | 90.0° |
| OD2 | CG | CB | CA | 170.0° | 150.0° |
| OD2 | CG | CB | H5 | 48.6° | 30.0° |
| CG | CB | CA | N | 62.3° | 55.0° |
| CG | CB | SB | CA | 119.5° | 120.0° |
| CG | CB | SB | H5 | 122.7° | 120.0° |
| CG | CB | SB | CB1 | 164.2° | 65.0° |
| CG | CB | CA | H5 | 121.5° | 120.0° |
| CG | CB | CA | C | 62.0° | 175.0° |
| CG | CB | CA | HA | 178.6° | 65.0° |
| CB | CG | OD2 | H9 | 180.0° | 180.0° |
| N | CA | CB | SB | 60.7° | 175.0° |
| N | CA | CB | C | 124.3° | 120.0° |
| N | CA | CB | HA | 119.1° | 120.0° |
| N | CA | C | HA | 116.9° | 120.1° |
| N | CA | C | O | 162.6° | 19.9° |
| N | CA | C | OXT | 18.3° | 160.0° |
| CA | N | H | H2 | 120.0° | 123.9° |
| N | CA | CB | H5 | 176.2° | 65.0° |
| SB | CB | CA | H5 | 115.5° | 119.9° |
| SB | CB | CA | C | 175.1° | 65.0° |
| SB | CB | CA | HA | 58.5° | 55.0° |
| CB | SB | CB1 | H6 | 180.0° | 60.1° |
| CB | SB | CB1 | H7 | 60.0° | 180.0° |
| CB | SB | CB1 | H8 | 60.0° | 60.0° |
| CB1 | SB | CB | CA | 76.2° | 175.0° |
| CB1 | SB | CB | H5 | 41.5° | 55.1° |
| SB | CB1 | H6 | H7 | 120.0° | 120.0° |
| SB | CB1 | H6 | H8 | 120.0° | 120.1° |
| SB | CB1 | H7 | H8 | 120.0° | 120.0° |
| CB | CA | C | HA | 116.5° | 120.0° |
| CB | CA | C | O | 36.0° | 100.0° |
| CB | CA | C | OXT | 144.9° | 80.0° |
| CB | CA | N | H | 180.0° | 176.1° |
| CB | CA | N | H2 | 60.0° | 60.0° |
| CA | C | O | OXT | 179.0° | 179.9° |
| C | CA | N | H | 55.0° | 63.9° |
| C | CA | N | H2 | 65.1° | 59.9° |
| C | CA | CB | H5 | 59.5° | 55.0° |
| CA | C | OXT | HXT | 179.0° | 179.9° |
| O | C | CA | HA | 80.5° | 140.0° |
| O | C | OXT | HXT | 0.0° | 0.0° |
| OXT | C | CA | HA | 98.6° | 39.9° |
| H | N | CA | HA | 61.4° | 56.1° |
| H2 | N | CA | HA | 178.6° | 180.0° |
| HA | CA | CB | H5 | 57.1° | 175.0° |
| H6 | CB1 | H7 | H8 | 120.0° | 120.0° |
